2-{[(2-phenylquinazolin-4-yl)sulfanyl]methyl}-3-[2-(trifluoromethyl)phenyl]quinazolin-4(3H)-one
Chemical Structure Depiction of
2-{[(2-phenylquinazolin-4-yl)sulfanyl]methyl}-3-[2-(trifluoromethyl)phenyl]quinazolin-4(3H)-one
2-{[(2-phenylquinazolin-4-yl)sulfanyl]methyl}-3-[2-(trifluoromethyl)phenyl]quinazolin-4(3H)-one
Compound characteristics
| Compound ID: | 5241-0533 |
| Compound Name: | 2-{[(2-phenylquinazolin-4-yl)sulfanyl]methyl}-3-[2-(trifluoromethyl)phenyl]quinazolin-4(3H)-one |
| Molecular Weight: | 540.57 |
| Molecular Formula: | C30 H19 F3 N4 O S |
| Smiles: | C(C1=Nc2ccccc2C(N1c1ccccc1C(F)(F)F)=O)Sc1c2ccccc2nc(c2ccccc2)n1 |
| Stereo: | ACHIRAL |
| logP: | 7.0255 |
| logD: | 7.0104 |
| logSw: | -6.4202 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 42.439 |
| InChI Key: | JVHCATHSYBWIIG-UHFFFAOYSA-N |